N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-cyclopentyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-cyclopentyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-cyclopentyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C329-0457 |
| Compound Name: | N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-cyclopentyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 511.67 |
| Molecular Formula: | C31 H37 N5 O2 |
| Smiles: | Cn1c2C(N(C=C(C(NCCN3CCN(CC3)Cc3ccccc3)=O)c2c2ccccc12)C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8638 |
| logD: | 2.5615 |
| logSw: | -3.1562 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.654 |
| InChI Key: | OAQQFEOOPGENSE-UHFFFAOYSA-N |